2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid
TL;DR: 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid (CAS 1026766-34-6) is a chemical compound with molecular formula C16H24ClN3O3 and molecular weight 341.1506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid
Also Known As: 2-(6-aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid, VU0512757-1, F3177-0027, 2-((6-aminohexyl)amino)-4-((2-chlorophenyl)amino)-4-oxobutanoic acid, 2-(6-aminohexylamino)-3-[(2-chlorophenyl)carbamoyl]propanoic Acid
Technical Specifications
| Molecular Formula | C16H24ClN3O3 |
| Molecular Weight | 341.1506 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 341.1506 Da |
| Heavy Atoms | 23 |
| Complexity | 368.0 |
| SMILES | C1=CC=C(C(=C1)NC(=O)CC(C(=O)O)NCCCCCCN)Cl |
| InChIKey | DRYJCVAJJJDUMD-UHFFFAOYSA-N |
Chemical Property Profile of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid
Property Insights of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid
The XLogP value of -0.4 indicates that 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid?
The CAS number of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid is 1026766-34-6.
What is the molecular formula of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid?
The molecular formula of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid is C16H24ClN3O3.
What is the molecular weight of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid?
The molecular weight of 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid is 341.1506 g/mol.
Where can I buy 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid?
You can request a quote for 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(6-Aminohexylamino)-4-(2-chloroanilino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.